1-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1,4-diazepan-1-yl]-2-(4-phenylphenyl)ethanone

Systemtic Name: 1-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1,4-diazepan-1-yl]-2-(4-phenylphenyl)ethanone Openeye Name: 1-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)-1,4-diazepan-1-yl]-2-(4-phenylphenyl)ethanone CAS Name: 1-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1,4-diazepan-1-yl]-2-(4-phenylphenyl)ethanone IUPAC Name: 1-[4-(2-oxo-2-pyrrolidin-1-ylethyl)-1,4-diazepan-1-yl]-2-(4-phenylphenyl)ethanone Traditional Name: 1-[4-(2-keto-2-pyrrolidino-ethyl)-1,4-diazepan-1-yl]-2-(4-phenylphenyl)ethanone Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCCN(CC2)C(=O)CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCCN(CC2)C(=O)CC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H31N3O2/c29-24(19-21-9-11-23(12-10-21)22-7-2-1-3-8-22)28-16-6-13-26(17-18-28)20-25(30)27-14-4-5-15-27/h1-3,7-12H,4-6,13-20H2